2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol

C8H22N2O3 — CID 21388893

IUPAC2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol
SMILESCC(C)(N)CO.OCCNCCO
InChIInChI=1S/C4H11NO2.C4H11NO/c6-3-1-5-2-4-7;1-4(2,5)3-6/h5-7H,1-4H2;6H,3,5H2,1-2H3
InChIKeyJSPCHAPZMGDONL-UHFFFAOYSA-N
MW194.27 g/mol
LogP-1.72
Rot. Bonds5

About 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol

2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol (PubChem CID 21388893) has the molecular formula C8H22N2O3 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol.

Molecular Properties

Compound Name2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol
PubChem CID21388893
Molecular FormulaC8H22N2O3
Molecular Weight194.27 g/mol
Exact Mass194.16
IUPAC Name2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol
SMILESCC(C)(N)CO.OCCNCCO
InChIInChI=1S/C4H11NO2.C4H11NO/c6-3-1-5-2-4-7;1-4(2,5)3-6/h5-7H,1-4H2;6H,3,5H2,1-2H3
InChIKeyJSPCHAPZMGDONL-UHFFFAOYSA-N
XLogP-1.72
TPSA98.74 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 5-1.72
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol?
The IUPAC name of 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol (CID 21388893) is 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol.
What is the SMILES notation for 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol?
The canonical SMILES for 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol is CC(C)(N)CO.OCCNCCO.
What is the InChIKey of 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol?
The InChIKey is JSPCHAPZMGDONL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO2.C4H11NO/c6-3-1-5-2-4-7;1-4(2,5)3-6/h5-7H,1-4H2;6H,3,5H2,1-2H3.
What are the key properties of 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol?
2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol has a molecular weight of 194.27 g/mol, XLogP of -1.72, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methylpropan-1-ol;2-(2-hydroxyethylamino)ethanol is sourced from PubChem (CID 21388893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).